4K7N
HUMAN PEROXIREDOXIN 5 with a fragment
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-03-09 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.977 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 80.115, 101.527, 155.562 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.900 - 2.300 |
Rwork | 0.188 |
R-free | 0.23211 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1hd2 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.900 | 48.900 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.057 | |
Number of reflections | 26994 | |
<I/σ(I)> | 9.1 | |
Completeness [%] | 99.7 | 99.7 |
Redundancy | 5.7 | 5.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.3 | 291 | 22% PEG3350, 0.1M sodium citrate buffer, 0.2M potassium sodium tartrate, 5mM 1,4-dithio-dl-threitol, 0.02%(w/v) sodium azide, pH 5.3, VAPOR DIFFUSION, HANGING DROP, temperature 291K |